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N-Acylkansosamine

CAT: 0804-HY-126847Size: 1 EachDry Ice: NoHazardous: No
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Description
N-Acylkansosamine is an N-acylamino sugar that can be isolated from the trehalose-containing lipooligosaccharide antigens of Mycobacterium kansasii[1].
CAS Number
92355-88-9
UNSPSC
12352211
Target
Biochemical Assay Reagents
Type
Reference compound
Related Pathways
Others
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/n-acylkansosamine.html
Solubility
10 mM in DMSO
Smiles
O=C[C@@H]([C@]([C@@H](NC(C(OC)C)=O)[C@H](C)O)(C)O)OC
Molecular Formula
C12H23NO6
Molecular Weight
277.31
References & Citations
[1]S W Hunter, et al. N-acylkansosamine. A novel N-acylamino sugar from the trehalose-containing lipooligosaccharide antigens of Mycobacterium kansasii. J Biol Chem. 1984 Aug 10;259 (15) :9729-34.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

N-Acylkansosamine

N-acylamino sugar from trehalose-containing lipopolysaccharide antigens of Mycobacterium kansasii

CAS Number92355-88-9
PubChem CID196306
IUPAC NameN-[(2S,3S,4R,5R)-2,4-dihydroxy-5-methoxy-4-methyl-6-oxohexan-3-yl]-2-methoxypropanamide
Molecular FormulaC12H23NO6
Molecular Weight277.31
XLogP-1.4
Topological Polar Surface Area105
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Heavy Atom Count19
Formal Charge0
Complexity311
SMILES
C[C@@H]([C@@H]([C@](C)([C@H](C=O)OC)O)NC(=O)C(C)OC)O
InChI
InChI=1S/C12H23NO6/c1-7(15)10(13-11(16)8(2)18-4)12(3,17)9(6-14)19-5/h6-10,15,17H,1-5H3,(H,13,16)/t7-,8?,9-,10-,12-/m0/s1
InChIKey
KHYJVZNVWDCCAY-HIVFNARLSA-N
Chemical Structure
2D Structure
2D structure of N-Acylkansosamine
CAS: 92355-88-9
CID: 196306
Formula: C12H23NO6
MW: 277.31
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight277.31
XLogP3-1.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Exact Mass277.15253745
Monoisotopic Mass277.15253745
Topological Polar Surface Area105 Ų
Heavy Atom Count19
Formal Charge0
Complexity311
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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